N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]piazthiole-4-sulfonamide Formula: C15H19N5O3S2 MolecularWeight: 381.47306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NS(=O)(=O)C2=CC=CC3=NSN=C32)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NS(=O)(=O)C2=CC=CC3=NSN=C32)OC

InChI

InChI=1S/C15H19N5O3S2/c1-15(2,23-3)7-8-20-10-11(9-16-20)19-25(21,22)13-6-4-5-12-14(13)18-24-17-12/h4-6,9-10,19H,7-8H2,1-3H3